SCHEMBL4946478

SCHEMBL4946478

CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2ccc(-n3cccn3)cc2)C1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.64
HDAC4 P56524 3/20 0.56
HDAC6 Q9UBN7 2/20 0.56
USP30 Q70CQ3 11/20 0.55
DGAT2 Q96PD7 2/20 0.52
PIK3CD O00329 1/20 0.51
PARP1 P09874 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3668182 1.00 GPR119 (0.64) GPR119HDAC4HDAC6USP30DGAT2
SCHEMBL3638282 0.94 GPR119 (0.69) GPR119HDAC4HDAC6USP30PIK3CD
SCHEMBL4943304 0.84 HDAC6 (0.54) GPR119HDAC4HDAC6USP30DGAT2
SCHEMBL3674391 0.84 HDAC6 (0.54) GPR119HDAC4HDAC6USP30DGAT2
SCHEMBL242088 0.82 USP30 (0.68) GPR119HDAC4HDAC6USP30PARP1
SCHEMBL242087 0.82 USP30 (0.68) GPR119HDAC4HDAC6USP30PARP1
SCHEMBL4921150 0.82 USP30 (0.71) HDAC4HDAC6USP30PARP1
SCHEMBL4924196 0.82 USP30 (0.71) HDAC4HDAC6USP30PARP1
SCHEMBL994594 0.82 USP30 (0.71) HDAC4HDAC6USP30PARP1
SCHEMBL3730320 0.81 HDAC4 (0.55) HDAC4HDAC6USP30DGAT2PARP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-11-27 US disclosed
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-11-27 US disclosed
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-11-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS HRH4, HRH3, HRH2 GPR119 655/4885HDAC4 652/4885HDAC6 425/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.